Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3hot_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N ASN 3.A OD1 no hydrogen 2.785 N/A GLN 6.A N ASN 3.A OD1 no hydrogen 2.731 N/A THR 7.A N ASN 3.A O no hydrogen 2.528 N/A THR 7.A OG1 ASN 3.A O no hydrogen 3.077 N/A ARG 8.A NH2 VAL 56.A O no hydrogen 2.955 N/A THR 9.A N GLU 5.A O no hydrogen 2.954 N/A THR 9.A OG1 GLU 5.A O no hydrogen 3.479 N/A VAL 10.A N GLN 6.A O no hydrogen 2.941 N/A LEU 11.A N THR 7.A O no hydrogen 3.210 N/A ILE 12.A N ARG 8.A O no hydrogen 3.174 N/A ILE 12.A N THR 9.A O no hydrogen 2.769 N/A PHE 13.A N THR 9.A O no hydrogen 3.189 N/A CYS 14.A N VAL 10.A O no hydrogen 2.679 N/A PHE 15.A N LEU 11.A O no hydrogen 2.926 N/A HIS 16.A N ILE 12.A O no hydrogen 3.008 N/A LYS 18.A N PHE 15.A O no hydrogen 2.711 N/A LYS 19.A NZ GLU 23.A O no hydrogen 2.944 N/A GLU 23.A N THR 20.A OG1 no hydrogen 3.130 N/A SER 24.A N THR 20.A O no hydrogen 2.838 N/A HIS 25.A N ALA 21.A O no hydrogen 2.758 N/A ARG 26.A N ALA 22.A O no hydrogen 3.079 N/A LEU 28.A N SER 24.A O no hydrogen 3.328 N/A VAL 29.A N HIS 25.A O no hydrogen 3.084 N/A GLU 30.A N ARG 26.A O no hydrogen 3.244 N/A GLU 30.A N MET 27.A O no hydrogen 2.812 N/A ALA 31.A N MET 27.A O no hydrogen 2.870 N/A PHE 32.A N LEU 28.A O no hydrogen 2.821 N/A CYS 42.A N THR 38.A O no hydrogen 3.000 N/A CYS 42.A N VAL 39.A O no hydrogen 2.703 N/A CYS 42.A SG THR 38.A O no hydrogen 3.758 N/A GLU 43.A N VAL 39.A O no hydrogen 2.814 N/A ARG 44.A N LYS 40.A O no hydrogen 3.068 N/A TRP 45.A N THR 41.A O no hydrogen 3.200 N/A PHE 46.A N CYS 42.A O no hydrogen 2.807 N/A GLN 47.A N GLU 43.A O no hydrogen 3.247 N/A PHE 49.A N TRP 45.A O no hydrogen 2.935 N/A PHE 49.A N PHE 46.A O no hydrogen 2.761 N/A LYS 50.A N PHE 46.A O no hydrogen 3.096 N/A GLY 52.A N ARG 48.A O no hydrogen 3.024 N/A LYS 63.A NZ GLU 60.A OE2 no hydrogen 2.579 N/A LYS 66.A NZ ASP 70.A OD1 no hydrogen 3.065 N/A TYR 68.A OH ALA 98.A O no hydrogen 3.281 N/A GLU 69.A N GLU 69.A OE2 no hydrogen 2.648 N/A GLU 72.A N GLU 69.A O no hydrogen 3.193 N/A GLN 74.A N ASP 70.A O no hydrogen 3.178 N/A LEU 76.A N LEU 73.A O no hydrogen 2.872 N/A LEU 77.A N LEU 73.A O no hydrogen 3.422 N/A ASP 78.A N GLN 74.A O no hydrogen 3.221 N/A GLU 79.A N ALA 75.A O no hydrogen 3.310 N/A ASP 80.A N LEU 76.A O no hydrogen 3.142 N/A ALA 82.A N ASP 80.A OD1 no hydrogen 2.992 N/A GLN 83.A NE2 ASP 80.A O no hydrogen 3.158 N/A GLN 87.A N THR 84.A O no hydrogen 2.710 N/A GLN 87.A NE2 THR 84.A OG1 no hydrogen 3.143 N/A LEU 88.A N THR 84.A O no hydrogen 3.020 N/A ALA 89.A N GLN 85.A O no hydrogen 2.860 N/A GLN 91.A NE2 GLN 83.A OE1 no hydrogen 2.866 N/A GLN 91.A NE2 GLN 87.A O no hydrogen 3.071 N/A LEU 92.A N ALA 89.A O no hydrogen 2.832 N/A GLU 93.A N GLU 90.A O no hydrogen 3.522 N/A SER 95.A OG GLN 97.A OE1 no hydrogen 3.562 N/A GLN 97.A N GLN 97.A OE1 no hydrogen 2.468 N/A ALA 98.A N SER 95.A OG no hydrogen 3.270 N/A VAL 99.A N GLN 96.A O no hydrogen 2.544 N/A SER 100.A N GLN 96.A O no hydrogen 2.938 N/A ASN 101.A N GLN 97.A O no hydrogen 3.177 N/A ARG 102.A NE TYR 68.A O no hydrogen 3.408 N/A ARG 102.A NH1 TYR 68.A O no hydrogen 2.715 N/A LEU 103.A N VAL 99.A O no hydrogen 3.094 N/A ARG 104.A N SER 100.A O no hydrogen 2.857 N/A GLU 105.A N ASN 101.A O no hydrogen 2.652 N/A MET 106.A N ARG 102.A O no hydrogen 2.576 N/A LYS 108.A NZ GLN 74.A OE1 no hydrogen 2.850 N/A ARG 114.A NE GLU 338.A OE2 no hydrogen 3.475 N/A MET 125.A N ASN 121.A O no hydrogen 2.722 N/A GLU 126.A N GLU 122.A O no hydrogen 3.331 N/A ARG 127.A N ARG 123.A O no hydrogen 2.900 N/A ARG 128.A N GLN 124.A O no hydrogen 3.264 N/A ARG 128.A N MET 125.A O no hydrogen 2.832 N/A ARG 128.A NE SER 270.A OG no hydrogen 2.418 N/A ARG 128.A NH1 LYS 335.A O no hydrogen 2.525 N/A ARG 128.A NH2 ASP 272.A OD2 no hydrogen 2.874 N/A LYS 129.A N MET 125.A O no hydrogen 2.910 N/A LYS 129.A NZ GLU 133.A OE2 no hydrogen 3.480 N/A ASN 130.A N GLU 126.A O no hydrogen 3.088 N/A ASN 130.A ND2 GLU 126.A O no hydrogen 2.971 N/A THR 131.A N ARG 127.A O no hydrogen 3.441 N/A THR 131.A OG1 ARG 127.A O no hydrogen 2.736 N/A CYS 132.A N ARG 128.A O no hydrogen 2.944 N/A CYS 132.A SG ARG 128.A O no hydrogen 3.448 N/A GLU 133.A N LYS 129.A O no hydrogen 2.627 N/A ILE 134.A N ASN 130.A O no hydrogen 2.576 N/A LEU 135.A N THR 131.A O no hydrogen 2.724 N/A LEU 136.A N CYS 132.A O no hydrogen 2.901 N/A SER 137.A N GLU 133.A O no hydrogen 3.185 N/A ARG 138.A N ILE 134.A O no hydrogen 3.055 N/A TYR 139.A N LEU 136.A O no hydrogen 3.183 N/A LYS 140.A N LEU 136.A O no hydrogen 3.274 N/A ARG 141.A N SER 137.A O no hydrogen 3.398 N/A LYS 142.A N TYR 139.A O no hydrogen 3.096 N/A SER 143.A OG HIS 146.A NE2 no hydrogen 2.664 N/A ARG 147.A N PHE 144.A O no hydrogen 3.032 N/A ILE 148.A N LEU 145.A O no hydrogen 2.693 N/A VAL 149.A N ILE 238.A O no hydrogen 2.923 N/A THR 150.A N TRP 193.A O no hydrogen 3.033 N/A THR 150.A OG1 LEU 240.A O no hydrogen 2.597 N/A GLY 151.A N LEU 240.A O no hydrogen 3.452 N/A ASP 152.A N VAL 191.A O no hydrogen 3.238 N/A LYS 154.A N LEU 189.A O no hydrogen 2.949 N/A ILE 156.A N THR 187.A O no hydrogen 3.200 N/A PHE 158.A N LYS 185.A O no hydrogen 3.204 N/A ASN 160.A N GLN 291.A O no hydrogen 3.086 N/A LYS 162.A NZ ASN 160.A O no hydrogen 3.263 N/A THR 175.A N SER 166.A OG no hydrogen 2.809 N/A THR 187.A N ILE 156.A O no hydrogen 3.339 N/A MET 188.A N LEU 204.A O no hydrogen 3.294 N/A LEU 189.A N LYS 154.A O no hydrogen 3.038 N/A CYS 190.A N GLU 202.A O no hydrogen 2.913 N/A VAL 191.A N ASP 152.A O no hydrogen 3.245 N/A TRP 192.A N TYR 200.A O no hydrogen 3.002 N/A TRP 193.A N THR 150.A O no hydrogen 2.752 N/A ASP 194.A N GLY 197.A O no hydrogen 2.869 N/A GLN 195.A NE2 HIS 146.A ND1 no hydrogen 3.600 N/A SER 196.A N ASP 194.A OD1 no hydrogen 2.782 N/A SER 196.A OG ASP 194.A OD1 no hydrogen 3.256 N/A GLY 197.A N ASP 194.A OD1 no hydrogen 3.162 N/A ILE 199.A N TRP 192.A O no hydrogen 3.113 N/A TYR 200.A N TRP 192.A O no hydrogen 3.386 N/A TYR 200.A OH GLU 202.A OE2 no hydrogen 2.566 N/A TYR 201.A OH ASP 304.A OD2 no hydrogen 2.693 N/A GLU 202.A N CYS 190.A O no hydrogen 2.697 N/A LEU 204.A N MET 188.A O no hydrogen 2.755 N/A THR 209.A N GLU 208.A OE2 no hydrogen 3.334 N/A ARG 214.A N ASN 211.A OD1 no hydrogen 2.922 N/A TYR 215.A N ASN 211.A O no hydrogen 3.054 N/A TYR 215.A OH HIS 241.A ND1 no hydrogen 3.079 N/A GLN 217.A N ALA 213.A O no hydrogen 3.318 N/A GLN 218.A N ARG 214.A O no hydrogen 3.210 N/A LEU 219.A N TYR 215.A O no hydrogen 2.670 N/A ILE 220.A N GLN 216.A O no hydrogen 2.799 N/A ASN 221.A N GLN 217.A O no hydrogen 2.799 N/A ASN 221.A ND2 GLN 217.A O no hydrogen 2.738 N/A LEU 222.A N GLN 218.A O no hydrogen 2.559 N/A ASN 223.A N LEU 219.A O no hydrogen 3.001 N/A ASN 223.A ND2 GLN 227.A OE1 no hydrogen 3.401 N/A ARG 224.A N ILE 220.A O no hydrogen 2.867 N/A ALA 225.A N ASN 221.A O no hydrogen 2.964 N/A LEU 226.A N LEU 222.A O no hydrogen 2.591 N/A GLN 227.A N ASN 223.A O no hydrogen 2.889 N/A LYS 229.A N ALA 225.A O no hydrogen 3.205 N/A ARG 230.A N LEU 226.A O no hydrogen 2.905 N/A ARG 230.A NE ASP 194.A OD1 no hydrogen 3.309 N/A ARG 230.A NE ASP 194.A OD2 no hydrogen 2.799 N/A ARG 230.A NE SER 196.A OG no hydrogen 3.415 N/A ARG 230.A NH1 LYS 229.A O no hydrogen 2.941 N/A ARG 230.A NH2 ASP 194.A OD1 no hydrogen 3.361 N/A TYR 233.A N ARG 230.A O no hydrogen 3.468 N/A TYR 233.A OH HIS 146.A O no hydrogen 2.953 N/A PHE 239.A N GLU 262.A O no hydrogen 2.490 N/A LEU 240.A N VAL 149.A O no hydrogen 3.151 N/A HIS 241.A ND1 TYR 215.A OH no hydrogen 3.079 N/A ASN 243.A ND2 HIS 266.A O no hydrogen 3.364 N/A HIS 247.A ND1 ASP 242.A O no hydrogen 2.778 N/A THR 248.A N ALA 244.A O no hydrogen 3.042 N/A ALA 249.A N SER 246.A O no hydrogen 3.211 N/A ARG 253.A N ALA 249.A O no hydrogen 3.172 N/A ARG 253.A NH1 THR 248.A O no hydrogen 2.878 N/A ASP 254.A N ARG 250.A O no hydrogen 3.097 N/A THR 255.A N ALA 251.A O no hydrogen 3.323 N/A THR 255.A OG1 ALA 251.A O no hydrogen 3.386 N/A LEU 256.A N VAL 252.A O no hydrogen 2.750 N/A GLU 257.A N ARG 253.A O no hydrogen 2.965 N/A THR 258.A N ASP 254.A O no hydrogen 3.016 N/A THR 258.A OG1 ASP 254.A O no hydrogen 2.741 N/A LEU 259.A N LEU 256.A O no hydrogen 3.023 N/A ASN 260.A N GLU 257.A O no hydrogen 3.156 N/A TRP 261.A N LEU 256.A O no hydrogen 3.461 N/A GLU 262.A N VAL 237.A O no hydrogen 2.965 N/A LEU 264.A N PHE 239.A O no hydrogen 2.920 N/A SER 270.A OG ALA 268.A O no hydrogen 3.095 N/A LEU 273.A N SER 270.A O no hydrogen 2.865 N/A ALA 274.A N PRO 271.A O no hydrogen 2.849 N/A ASP 277.A N ALA 274.A O no hydrogen 2.844 N/A TYR 278.A N ALA 274.A O no hydrogen 3.161 N/A TYR 278.A OH GLY 318.A O no hydrogen 3.212 N/A HIS 279.A N PRO 275.A O no hydrogen 2.857 N/A LEU 280.A N PRO 275.A O no hydrogen 3.186 N/A PHE 281.A N SER 276.A O no hydrogen 2.786 N/A SER 283.A N HIS 279.A O no hydrogen 3.380 N/A MET 284.A N LEU 280.A O no hydrogen 3.250 N/A GLY 285.A N PHE 281.A O no hydrogen 2.792 N/A ALA 287.A N SER 283.A O no hydrogen 3.346 N/A LEU 288.A N MET 284.A O no hydrogen 2.737 N/A ALA 289.A N HIS 286.A O no hydrogen 3.458 N/A GLU 290.A N ASN 160.A O no hydrogen 2.945 N/A GLN 291.A N LEU 288.A O no hydrogen 3.355 N/A TYR 296.A OH LEU 203.A O no hydrogen 3.282 N/A SER 298.A N SER 295.A OG no hydrogen 2.872 N/A VAL 299.A N SER 295.A O no hydrogen 3.292 N/A LYS 300.A N TYR 296.A O no hydrogen 3.314 N/A LYS 301.A N GLU 297.A O no hydrogen 2.712 N/A TRP 302.A N SER 298.A O no hydrogen 2.987 N/A LEU 303.A N VAL 299.A O no hydrogen 2.806 N/A ASP 304.A N LYS 300.A O no hydrogen 2.778 N/A GLU 305.A N LYS 301.A O no hydrogen 2.950 N/A TRP 306.A N TRP 302.A O no hydrogen 2.767 N/A PHE 307.A N LEU 303.A O no hydrogen 2.953 N/A ALA 308.A N ASP 304.A O no hydrogen 3.127 N/A ALA 309.A N GLU 305.A O no hydrogen 2.925 N/A LYS 310.A N PHE 307.A O no hydrogen 3.279 N/A LYS 310.A NZ SER 283.A OG no hydrogen 3.351 N/A ASP 312.A N ASP 311.A OD1 no hydrogen 2.466 N/A TYR 315.A N ASP 312.A O no hydrogen 3.358 N/A ARG 317.A N GLU 313.A O no hydrogen 2.820 N/A ARG 317.A NH1 PHE 314.A O no hydrogen 3.307 N/A GLY 318.A N PHE 314.A O no hydrogen 3.326 N/A ILE 319.A N TYR 315.A O no hydrogen 3.011 N/A HIS 320.A N TRP 316.A O no hydrogen 2.736 N/A LYS 321.A N ARG 317.A O no hydrogen 2.890 N/A LYS 321.A N GLY 318.A O no hydrogen 3.199 N/A LYS 321.A NZ HIS 279.A ND1 no hydrogen 3.263 N/A LEU 322.A N ILE 319.A O no hydrogen 3.281 N/A ARG 325.A N LYS 321.A O no hydrogen 3.111 N/A ARG 325.A NE ASP 272.A O no hydrogen 2.624 N/A TRP 326.A N LEU 322.A O no hydrogen 2.783 N/A TRP 326.A N PRO 323.A O no hydrogen 2.868 N/A GLU 327.A N PRO 323.A O no hydrogen 2.886 N/A LYS 328.A N GLU 324.A O no hydrogen 2.859 N/A VAL 330.A N TRP 326.A O no hydrogen 2.990 N/A ALA 331.A N GLU 327.A O no hydrogen 3.288 N/A SER 332.A N CYS 329.A O no hydrogen 3.315 N/A SER 332.A OG LYS 328.A O no hydrogen 3.549 N/A ASP 333.A N VAL 330.A O no hydrogen 2.926 N/A GLY 334.A N CYS 329.A O no hydrogen 3.116 N/A TYR 336.A OH TYR 269.A O no hydrogen 2.833 N/A